SMILES:
CCCC1(CCO)OCCO1Molecular Processing
Molecular formula
C8H16O3
Molecular weight
160.21
Exact mass
160.1099
XLogP
0.91
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
41.25
Supplementary Information
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